2-azanyl-6-(2-hydroxyethylsulfanyl)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(2-hydroxyethylsulfanyl)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-(2-hydroxyethylsulfanyl)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(2-hydroxyethylthio)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-hydroxyethylsulfanyl)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(2-hydroxyethylthio)-4-(3,4,5-trimethoxyphenyl)dinicotinonitrile Formula: C18H18N4O4S MolecularWeight: 386.42492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SCCO)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SCCO)N)C#N

InChI

InChI=1S/C18H18N4O4S/c1-24-13-6-10(7-14(25-2)16(13)26-3)15-11(8-19)17(21)22-18(12(15)9-20)27-5-4-23/h6-7,23H,4-5H2,1-3H3,(H2,21,22)